4-[[4-[(Z)-2-(4-ethylphenyl)ethenyl]pyridin-1-ium-1-yl]methyl]benzoate

Systemtic Name: 4-[[4-[(Z)-2-(4-ethylphenyl)ethenyl]pyridin-1-ium-1-yl]methyl]benzoate Openeye Name: 4-[[4-[(Z)-2-(4-ethylphenyl)vinyl]pyridin-1-ium-1-yl]methyl]benzoate CAS Name: 4-[[4-[(Z)-2-(4-ethylphenyl)ethenyl]-1-pyridin-1-iumyl]methyl]benzoate IUPAC Name: 4-[[4-[(Z)-2-(4-ethylphenyl)ethenyl]pyridin-1-ium-1-yl]methyl]benzoate Traditional Name: 4-[[4-[(Z)-2-(4-ethylphenyl)vinyl]pyridin-1-ium-1-yl]methyl]benzoate Formula: C23H21NO2 MolecularWeight: 343.41834

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=CC2=CC=[N+](C=C2)CC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C\C2=CC=[N+](C=C2)CC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C23H21NO2/c1-2-18-3-5-19(6-4-18)7-8-20-13-15-24(16-14-20)17-21-9-11-22(12-10-21)23(25)26/h3-16H,2,17H2,1H3/b8-7-